Glycoside
GD074444
Name:
NoneFormula:
C14H24O9N2SSmiles:
CCS(=O)(=O)N1C[C@@H]2OCCN(C(=O)[C@H]3O[C@H](O)[C@H](O)[C@@H](O)[C@H]3O)[C@H]2C1Aglycone:
CCS(=O)(=O)N1CC2OCCN(C=O)C2C1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.93 |
| AlogP: | -3.95 | Num_rotatable_bonds: | 3 |
| MolWt: | 396.42 | Num_heavy_atoms: | 26 |
| TPSA: | 157.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD34406
Formula: C9H16O4N2S
Smiles:
CCS(=O)(=O)N1CC2OCCN(C=O)C2C1| HBA: | 6 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.89 |
| AlogP: | -1.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 248.3 | Num_heavy_atoms: | 16 |
| TPSA: | 66.92 | NumAromaticRings: | 0 |
